⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4949512 | 0.86 | — | — | |
| SCHEMBL28276145 | 0.77 | TSHR (0.31) | — | |
| SCHEMBL737275 | 0.74 | — | — | |
| SCHEMBL7610331 | 0.72 | — | — | |
| SCHEMBL5364929 | 0.72 | — | — | |
| SCHEMBL25390364 | 0.72 | — | — | |
| SCHEMBL18843651 | 0.72 | — | — | |
| SCHEMBL28223606 | 0.72 | — | — | |
| SCHEMBL28161385 | 0.72 | — | — | |
| SCHEMBL1100301 | 0.69 | MAPT (0.31) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103080177-B | polyurethane with low volume shrinkage | 科思创德国股份有限公司 | 2016-09-21 | — | — | CN | disclosed |
| CN-103119077-B | There is the urethane of high light refraction | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-10-21 | — | — | CN | disclosed |
| CN-103201305-B | Polyisocyanate mixtures | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-10-07 | — | — | CN | disclosed |
| CN-101180352-B | Polyurethane or polyisocyanurate foam compositions comprising aprotic solvents | MOMENTIVE PERFORMANCE MAT INC | 2015-05-13 | — | — | CN | disclosed |
| CN-103201305-A | Polyisocyanate mixtures | BAYER MATERIALSCIENCE AG | 2013-07-10 | — | — | CN | disclosed |
| CN-103119077-A | Polyurethane having high light refraction | BAYER IP GMBH | 2013-05-22 | — | — | CN | disclosed |
| CN-103080177-A | Polyurethane with low volume shrinkage | BAYER IP GMBH | 2013-05-01 | — | — | CN | disclosed |
| CN-101180352-A | Polyurethane or polyisocyanurate foam compositions | GEN ELECTRIC (US) | 2008-05-14 | — | — | CN | disclosed |
| CN-1091589-C | Cleansing emulsions | PROCTER & GAMBLE (US) | 2002-10-02 | — | — | CN | disclosed |
| CN-1184417-A | Cleansing emulsions | PROCTER & GAMBLE (US) | 1998-06-10 | — | — | CN | disclosed |
| EP-0314507-B1 | Pastes for forming a luminescent layer or insulator layer of a dispersion type electroluminescence element and a dispersion type electroluminescence element | NIPPON KASEI CHEM (JP) | 1998-01-21 | — | — | EP | disclosed |
| US-5262544-A | Shockproof, heat resistant explosives | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1993-11-16 | — | — | US | disclosed |
| EP-0314507-A2 | Pastes for forming a luminescent layer or insulator layer of a dispersion type electroluminescence element and a dispersion type electroluminescence element | NIPPON KASEI CHEMICAL CO., LTD. (JP) | 1989-05-03 | — | — | EP | disclosed |
| CN-85109737-A | The perfumed soap that contains polymeric viscosifier | — | 1986-09-17 | — | — | CN | disclosed |